SCHEMBL7202278

SCHEMBL7202278

CCCCCCCCCCCCCC(=O)C(CCl)Cc1cccc(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 5/20 0.46
▸ EPHX1 P07099 3/20 0.45
▸ DUSP3 P51452 1/20 0.43
▸ PNMT P11086 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7202835 0.85 EPHX2 (0.49) EPHX2
SCHEMBL7200913 0.79 EPHX2 (0.48) EPHX2EPHX1PNMT
SCHEMBL8666117 0.76 EPHX2 (0.54) EPHX2
SCHEMBL7202275 0.75 CNR1 (0.47) —
SCHEMBL10708130 0.73 CTNNB1 (0.43) —
SCHEMBL2428654 0.73 EPHX2 (0.47) EPHX2EPHX1PNMT
SCHEMBL14953567 0.73 CYP2C19 (0.44) —
SCHEMBL4201810 0.72 EPHX2 (0.59) EPHX2
SCHEMBL4218833 0.72 EPHX2 (0.59) EPHX2
SCHEMBL4217650 0.72 EPHX2 (0.59) EPHX2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003010156-A1 METHOD FOR PREPARING $G(A)-HALOGENOALKYLARYLKETONES AND THEIR HALOGENATED INTERMEDIATE PRODUCTS RHODIA CHIMIE (FR) 2003-02-06 — — WO disclosed
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